#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2odx n LYS 95 N 0.00 0.00 -3.68 0.03 2.85 -1.26 -5.04 118.16 111.06 2odx n LYS 95 Ca 0.00 0.00 -0.28 0.00 -1.05 0.00 0.00 58.31 56.98 2odx n LYS 95 Cb 0.00 0.00 -0.12 0.00 -0.65 0.00 0.00 35.03 34.26 2odx n LYS 95 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2odx s ASP 96 N 0.48 3.39 -0.17 -5.58 2.15 -1.26 -4.77 116.67 110.92 2odx s ASP 96 Ca 0.00 -3.28 -0.20 0.00 0.43 0.00 0.00 52.55 49.50 2odx s ASP 96 Cb 0.00 -1.08 -0.23 0.00 -0.30 0.00 0.00 42.92 41.31 2odx s ASP 96 CO 0.00 -0.16 0.39 1.55 -0.17 0.00 0.00 175.17 176.78 2odx h PRO 97 N 5.82 0.08 -3.16 4.34 0.13 -1.92 -3.49 132.00 133.81 2odx h PRO 97 Ca 0.15 -0.14 -0.16 0.00 -0.87 0.00 0.00 66.00 64.98 2odx h PRO 97 Cb 0.85 0.05 -0.25 0.00 0.13 0.00 0.00 31.00 31.78 2odx h PRO 97 CO 0.54 1.07 -0.42 0.42 -0.23 0.00 0.00 178.00 179.38 2odx s ILE 98 N -2.39 0.01 -0.06 -3.56 -1.09 -1.26 -5.03 121.20 107.82 2odx s ILE 98 Ca -0.25 -0.09 0.00 0.00 -2.23 0.00 0.00 60.65 58.09 2odx s ILE 98 Cb 0.04 -0.38 -0.03 0.00 -1.58 0.00 0.00 42.46 40.51 2odx s ILE 98 CO 0.66 -0.05 -0.04 -0.63 -1.23 0.00 0.00 174.94 173.66 2odx s ILE 99 N -0.09 3.96 -0.22 2.92 -1.09 -1.26 -0.52 121.20 124.91 2odx s ILE 99 Ca -0.02 -0.44 -0.01 0.00 -2.23 0.00 0.00 60.65 57.95 2odx s ILE 99 Cb -0.02 -2.66 0.06 0.00 -1.58 0.00 0.00 42.46 38.26 2odx s ILE 99 CO 0.01 0.56 0.00 -0.63 -1.23 0.00 0.00 174.94 173.65 2odx s ILE 100 N -0.88 0.97 0.30 2.92 -1.09 -0.68 -4.93 121.20 117.81 2odx s ILE 100 Ca 0.14 -0.88 -0.29 0.00 -2.23 0.00 0.00 60.65 57.39 2odx s ILE 100 Cb -0.11 -1.39 -0.11 0.00 -1.58 0.00 0.00 42.46 39.28 2odx s ILE 100 CO 0.03 -0.18 1.45 -1.61 -1.23 0.00 0.00 174.94 173.40 2odx s GLU 101 N 1.65 4.23 -0.28 2.79 8.01 -1.26 -3.67 118.70 130.16 2odx s GLU 101 Ca -0.03 2.39 -0.19 0.00 0.01 0.00 0.00 54.97 57.15 2odx s GLU 101 Cb -0.18 -3.06 0.11 0.00 -4.31 0.00 0.00 34.13 26.70 2odx s GLU 101 CO -0.08 -0.44 0.89 0.45 0.01 0.00 0.00 175.26 176.10 2odx s SER 102 N 0.13 -0.63 0.00 -0.19 0.15 -1.26 -5.00 113.70 106.90 2odx s SER 102 Ca 0.57 1.07 0.28 0.00 0.70 0.00 0.00 55.95 58.57 2odx s SER 102 Cb -0.43 1.19 1.07 0.00 -1.71 0.00 0.00 66.02 66.13 2odx s SER 102 CO 0.50 -0.17 1.76 -1.22 1.20 0.00 0.00 173.24 175.30 2odx n TYR 103 N 3.33 0.00 -3.56 3.44 4.01 -1.26 -4.44 117.16 118.67 2odx n TYR 103 Ca -0.17 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.31 2odx n TYR 103 Cb 0.57 -0.13 -0.02 0.00 -0.31 0.00 0.00 39.34 39.44 2odx n TYR 103 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2odx s ASP 104 N -2.41 6.36 0.40 7.72 1.01 -1.26 -4.79 116.67 123.69 2odx s ASP 104 Ca 0.29 0.44 0.21 0.00 0.71 0.00 0.00 52.55 54.20 2odx s ASP 104 Cb 0.20 -2.03 0.70 0.00 1.01 0.00 0.00 42.92 42.80 2odx s ASP 104 CO 0.47 -0.15 1.73 -0.78 0.21 0.00 0.00 175.17 176.66 2odx h ASP 105 N 1.50 0.00 0.00 0.27 1.82 -1.94 -3.38 116.42 114.69 2odx h ASP 105 Ca -0.49 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.15 2odx h ASP 105 Cb 1.20 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.21 2odx h ASP 105 CO 0.65 0.29 0.00 0.00 -1.61 0.00 0.00 179.24 178.58 2odx n TYR 106 N -3.38 0.00 -1.54 0.28 0.18 -1.26 -0.04 117.16 111.40 2odx n TYR 106 Ca 0.01 -0.03 -0.53 0.00 1.88 0.00 0.00 57.90 59.22 2odx n TYR 106 Cb 0.50 -0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.40 2odx n TYR 106 CO 0.00 0.00 0.00 -2.13 -2.08 0.00 0.00 176.86 172.65 2odx n ARG 107 N -0.03 0.65 -2.51 -3.48 0.00 -1.26 -4.57 116.66 105.46 2odx n ARG 107 Ca 0.00 0.23 -0.33 0.00 -0.00 0.00 0.00 57.85 57.76 2odx n ARG 107 Cb 0.24 -1.73 -0.04 0.00 0.00 0.00 0.00 32.46 30.93 2odx n ARG 107 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.63 179.15 2odx s TYR 108 N -0.01 3.26 -0.04 -0.14 -0.85 -1.26 -4.33 117.35 113.98 2odx s TYR 108 Ca 0.82 1.54 -0.03 0.00 -0.52 0.00 0.00 57.07 58.87 2odx s TYR 108 Cb -1.03 -2.89 -0.04 0.00 0.38 0.00 0.00 41.96 38.38 2odx s TYR 108 CO 0.53 -0.46 0.14 0.54 -1.52 0.00 0.00 175.55 174.77 2odx s VAL 109 N -2.34 5.21 -0.81 -3.49 0.11 0.61 -4.90 120.40 114.78 2odx s VAL 109 Ca 0.62 -0.14 -0.12 0.00 -2.93 0.00 0.00 61.98 59.41 2odx s VAL 109 Cb -0.12 -3.37 0.21 0.00 -1.53 0.00 0.00 36.38 31.58 2odx s VAL 109 CO 0.24 0.41 0.73 -0.83 -3.33 0.00 0.00 175.10 172.33 2odx s GLY 110 N -1.62 2.67 -0.04 6.54 0.00 -1.25 -1.77 107.32 111.85 2odx s GLY 110 Ca 0.23 -3.34 -0.05 0.00 0.00 0.00 0.00 44.72 41.55 2odx s GLY 110 CO 0.13 1.24 0.20 0.00 0.00 0.00 0.00 173.10 174.66 2odx n THR 112 N 1.35 2.27 0.00 0.00 -2.24 -1.26 -1.32 114.28 113.08 2odx n THR 112 Ca -0.14 -2.38 0.00 0.00 -2.27 0.00 0.00 64.05 59.26 2odx n THR 112 Cb 0.53 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.49 2odx n THR 112 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2odx n GLY 113 N -0.99 -1.07 2.93 3.38 0.00 -1.26 -0.92 105.19 107.27 2odx n GLY 113 Ca 0.23 -2.14 -0.42 0.00 0.00 0.00 0.00 46.02 43.70 2odx n GLY 113 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2odx n SER 114 N 0.00 -0.97 0.12 1.61 2.88 -1.26 -4.79 113.62 111.20 2odx n SER 114 Ca 0.00 0.97 0.09 0.00 -1.33 0.00 0.00 58.87 58.60 2odx n SER 114 Cb 0.00 -0.81 0.44 0.00 -0.75 0.00 0.00 64.21 63.09 2odx n SER 114 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2odx n PRO 115 N 0.90 0.11 -0.07 -1.46 -0.04 -1.26 -2.04 135.00 131.15 2odx n PRO 115 Ca 0.16 0.58 0.08 0.00 -0.04 0.00 0.00 63.50 64.28 2odx n PRO 115 Cb 0.20 -1.84 0.32 0.00 -0.04 0.00 0.00 33.50 32.14 2odx n PRO 115 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2odx n ALA 116 N -1.71 2.52 -1.48 0.55 0.00 -1.26 -4.94 120.51 114.20 2odx n ALA 116 Ca -0.01 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.07 2odx n ALA 116 Cb 0.04 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.39 2odx n ALA 116 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2odx n GLY 117 N 0.94 -1.14 0.03 0.00 0.00 -0.86 -5.06 105.19 99.10 2odx n GLY 117 Ca 0.12 -0.15 -0.01 0.00 0.00 0.00 0.00 46.02 45.99 2odx n GLY 117 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2odx h SER 118 N 0.00 0.00 -0.70 1.61 0.02 -1.03 -3.50 113.55 109.95 2odx h SER 118 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2odx h SER 118 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2odx h SER 118 CO 0.00 0.31 0.00 0.00 -1.14 0.00 0.00 176.83 176.00 2odx n HIS 119 N -3.53 0.00 0.00 3.45 1.44 -0.54 -5.01 115.22 111.03 2odx n HIS 119 Ca -0.01 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.70 2odx n HIS 119 Cb 0.04 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.15 2odx n HIS 119 CO 0.00 0.00 0.00 -2.37 -2.81 0.00 0.00 176.34 171.16 2odx n THR 120 N 0.00 0.00 -4.97 0.61 5.66 -1.26 -4.91 114.28 109.41 2odx n THR 120 Ca 0.00 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.68 2odx n THR 120 Cb 0.00 -0.44 -0.14 0.00 -1.55 0.00 0.00 70.33 68.20 2odx n THR 120 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 2odx s ILE 121 N 0.00 2.70 0.20 1.09 1.10 -1.26 -4.18 121.20 120.85 2odx s ILE 121 Ca 0.00 -0.93 0.08 0.00 -0.51 0.00 0.00 60.65 59.29 2odx s ILE 121 Cb 0.00 -2.04 -0.05 0.00 0.15 0.00 0.00 42.46 40.52 2odx s ILE 121 CO 0.00 0.54 -0.15 -0.04 -2.11 0.00 0.00 174.94 173.18 2odx s MET 122 N -0.83 1.32 -0.56 3.50 -1.94 -0.44 -5.00 119.30 115.36 2odx s MET 122 Ca 0.12 -1.57 0.07 0.00 -1.71 0.00 0.00 55.69 52.59 2odx s MET 122 Cb -0.10 -1.15 0.28 0.00 2.01 0.00 0.00 34.83 35.86 2odx s MET 122 CO 0.01 0.20 0.75 0.91 -0.01 0.00 0.00 175.02 176.87 2odx n TRP 123 N -0.30 2.76 -2.80 -0.03 5.03 -1.24 -3.12 117.44 117.74 2odx n TRP 123 Ca -0.09 -3.99 -0.28 0.00 3.03 0.00 0.00 57.50 56.17 2odx n TRP 123 Cb 0.60 -0.50 -0.01 0.00 -1.03 0.00 0.00 31.31 30.37 2odx n TRP 123 CO 0.00 0.00 0.00 -0.51 -0.03 0.00 0.00 177.69 177.15 2odx s LEU 124 N -2.45 3.75 -0.59 -0.99 1.43 -0.73 -4.73 118.68 114.38 2odx s LEU 124 Ca 0.41 0.95 0.05 0.00 -1.03 0.00 0.00 54.13 54.52 2odx s LEU 124 Cb 0.19 -3.87 0.19 0.00 0.03 0.00 0.00 46.19 42.73 2odx s LEU 124 CO -0.06 -0.48 0.49 0.29 0.23 0.00 0.00 176.35 176.83 2odx n LYS 125 N -1.82 1.38 -0.69 1.70 5.02 -1.26 -0.29 118.16 122.20 2odx n LYS 125 Ca 0.01 -4.04 -0.13 0.00 -2.02 0.00 0.00 58.31 52.13 2odx n LYS 125 Cb 0.55 -2.01 0.06 0.00 -0.02 0.00 0.00 35.03 33.61 2odx n LYS 125 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2odx n PRO 126 N 1.98 1.66 0.00 1.97 -0.04 -1.26 -4.42 135.00 134.88 2odx n PRO 126 Ca 0.24 -1.44 0.00 0.00 -0.04 0.00 0.00 63.50 62.26 2odx n PRO 126 Cb 0.41 -1.56 0.00 0.00 -0.04 0.00 0.00 33.50 32.31 2odx n PRO 126 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2odx n THR 127 N -0.01 0.00 -0.05 0.52 -1.04 -1.26 -0.37 114.28 112.07 2odx n THR 127 Ca 0.28 0.00 0.13 0.00 -2.04 0.00 0.00 64.05 62.43 2odx n THR 127 Cb 0.86 0.00 0.54 0.00 -1.82 0.00 0.00 70.33 69.91 2odx n THR 127 CO 0.00 0.00 0.00 1.62 -0.64 0.00 0.00 175.07 176.05 2odx h VAL 128 N 0.00 0.87 0.00 12.58 3.04 -0.65 0.19 116.25 132.28 2odx h VAL 128 Ca 0.00 -0.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.58 2odx h VAL 128 Cb 0.00 0.53 0.00 0.00 -2.01 0.00 0.00 31.29 29.81 2odx h VAL 128 CO 0.00 0.06 0.00 0.59 -1.01 0.00 0.00 177.57 177.21 2odx n ASN 129 N -4.46 0.21 0.00 3.17 3.02 -1.26 -4.89 115.26 111.05 2odx n ASN 129 Ca 0.09 0.52 0.00 0.00 -0.03 0.00 0.00 54.58 55.17 2odx n ASN 129 Cb 0.41 -0.58 0.00 0.00 -0.61 0.00 0.00 39.78 39.00 2odx n ASN 129 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2odx n GLU 130 N -1.70 0.00 -3.74 3.52 1.02 0.68 -5.17 120.64 115.25 2odx n GLU 130 Ca 0.06 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.13 2odx n GLU 130 Cb 0.34 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.74 2odx n GLU 130 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2odx s VAL 131 N 1.54 0.00 -0.09 2.62 -7.23 -1.24 -4.58 120.40 111.42 2odx s VAL 131 Ca 0.00 -0.70 -0.12 0.00 -1.81 0.00 0.00 61.98 59.35 2odx s VAL 131 Cb 0.00 -1.78 0.03 0.00 0.56 0.00 0.00 36.38 35.19 2odx s VAL 131 CO 0.00 0.00 0.31 0.00 -0.31 0.00 0.00 175.10 175.10 2odx s ALA 132 N -3.68 -0.78 -0.07 1.32 0.00 -0.03 -4.41 121.76 114.12 2odx s ALA 132 Ca 0.09 0.72 -0.05 0.00 0.00 0.00 0.00 51.96 52.73 2odx s ALA 132 Cb -0.04 -0.35 -0.04 0.00 0.00 0.00 0.00 23.12 22.69 2odx s ALA 132 CO 0.02 -0.18 0.14 0.50 0.00 0.00 0.00 175.76 176.23 2odx s ARG 133 N -0.27 3.37 0.73 0.00 3.52 -1.26 -0.48 118.95 124.56 2odx s ARG 133 Ca -0.04 -0.25 -0.15 0.00 -0.13 0.00 0.00 55.73 55.16 2odx s ARG 133 Cb -0.03 -3.10 0.04 0.00 -1.56 0.00 0.00 34.95 30.30 2odx s ARG 133 CO 0.01 0.73 1.19 0.00 -0.81 0.00 0.00 175.30 176.42 2odx n TRP 135 N -2.74 0.00 0.00 0.00 4.27 -1.26 -4.07 117.44 113.64 2odx n TRP 135 Ca 0.13 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.74 2odx n TRP 135 Cb 0.51 -0.48 0.00 0.00 -1.36 0.00 0.00 31.31 29.97 2odx n TRP 135 CO 0.00 0.00 0.00 0.39 -2.29 0.00 0.00 177.69 175.79 2odx n GLU 136 N -2.23 0.00 0.06 -2.67 -0.58 -1.26 -4.54 120.64 109.41 2odx n GLU 136 Ca -0.04 0.00 0.10 0.00 -0.42 0.00 0.00 57.16 56.80 2odx n GLU 136 Cb 0.55 -0.11 0.42 0.00 -0.57 0.00 0.00 31.44 31.74 2odx n GLU 136 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2odx n GLY 138 N 0.30 0.55 3.75 0.00 0.00 -1.26 -5.00 105.19 103.54 2odx n GLY 138 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2odx n GLY 138 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2odx s SER 139 N -2.29 6.91 0.41 1.61 1.04 -1.26 -4.69 113.70 115.42 2odx s SER 139 Ca 0.00 2.49 -0.22 0.00 0.48 0.00 0.00 55.95 58.71 2odx s SER 139 Cb 0.00 -2.63 -0.11 0.00 0.10 0.00 0.00 66.02 63.39 2odx s SER 139 CO 0.00 -0.47 0.94 -0.69 0.98 0.00 0.00 173.24 174.00 2odx s VAL 140 N -0.57 4.37 0.13 5.02 1.01 -1.26 -1.09 120.40 128.00 2odx s VAL 140 Ca 0.52 1.54 0.06 0.00 0.00 0.00 0.00 61.98 64.10 2odx s VAL 140 Cb -0.37 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 2odx s VAL 140 CO 0.44 -0.23 -0.15 -0.31 0.00 0.00 0.00 175.10 174.85 2odx s TYR 141 N -2.07 1.49 0.07 5.22 1.51 0.37 -4.27 117.35 119.66 2odx s TYR 141 Ca 0.59 -0.53 0.01 0.00 -1.01 0.00 0.00 57.07 56.13 2odx s TYR 141 Cb -0.11 -0.77 -0.04 0.00 -0.11 0.00 0.00 41.96 40.93 2odx s TYR 141 CO 0.15 0.18 -0.05 0.21 -1.11 0.00 0.00 175.55 174.92 2odx s LYS 142 N -2.63 0.66 0.04 -0.62 2.36 0.33 -0.85 119.74 119.03 2odx s LYS 142 Ca 0.10 -1.13 0.05 0.00 -2.55 0.00 0.00 55.97 52.43 2odx s LYS 142 Cb -0.05 -0.06 -0.04 0.00 -1.05 0.00 0.00 37.83 36.63 2odx s LYS 142 CO 0.04 -0.04 -0.07 -1.17 1.55 0.00 0.00 175.35 175.66 2odx s LEU 143 N -2.61 3.15 0.13 5.43 0.20 0.50 -1.68 118.68 123.80 2odx s LEU 143 Ca 0.04 -0.22 0.02 0.00 0.69 0.00 0.00 54.13 54.65 2odx s LEU 143 Cb 0.02 -1.86 -0.04 0.00 -0.43 0.00 0.00 46.19 43.89 2odx s LEU 143 CO -0.05 0.24 0.27 0.54 -0.29 0.00 0.00 176.35 177.06 2odx s ASN 144 N -1.74 6.35 0.00 3.68 2.20 -1.24 -4.30 114.94 119.89 2odx s ASN 144 Ca 0.19 0.21 0.17 0.00 -0.94 0.00 0.00 52.86 52.49 2odx s ASN 144 Cb -0.11 -1.93 0.86 0.00 -2.00 0.00 0.00 41.25 38.07 2odx s ASN 144 CO 0.10 0.08 1.47 -0.81 -2.94 0.00 0.00 177.10 175.00 2odx n PRO 145 N -0.35 0.28 -1.43 3.55 -0.04 -1.26 -4.71 135.00 131.03 2odx n PRO 145 Ca -0.06 0.11 -0.45 0.00 -0.04 0.00 0.00 63.50 63.06 2odx n PRO 145 Cb 0.53 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.48 2odx n PRO 145 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2odx n VAL 146 N -1.24 1.71 -1.90 0.52 3.14 -1.26 -5.06 118.33 114.24 2odx n VAL 146 Ca 0.09 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.97 2odx n VAL 146 Cb 0.12 -0.33 0.00 0.00 -1.06 0.00 0.00 33.84 32.57 2odx n VAL 146 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98